SCHEMBL7252823

SCHEMBL7252823

O=C1CN(Cc2ccccc2)C(=O)CN1

nearest known ligand 0.57

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
GSK3A P49840 2/20 0.57
GSK3B P49841 2/20 0.57
EPHX2 P34913 1/20 0.54
HRH3 Q9Y5N1 1/20 0.52
DDB1 Q16531 1/20 0.50
CRBN Q96SW2 1/20 0.50
L3MBTL1 Q9Y468 1/20 0.46
HPGD P15428 1/20 0.44
TSHR P16473 1/20 0.44
GAA P10253 1/20 0.44
KMT2A Q03164 5/20 0.43
MEN1 O00255 4/20 0.43
POLB P06746 1/20 0.41
CYP2D6 P10635 1/20 0.41
CYP2C9 P11712 1/20 0.41
CYP2C19 P33261 1/20 0.41
F2 P00734 1/20 0.41
PLG P00747 1/20 0.41
ELANE P08246 1/20 0.41
CTSG P08311 1/20 0.41

Click a target to see other patent compounds predicted against it — the reverse direction, in place.

Similar compounds — the chemically nearest patent molecules

Nearest neighbours by Morgan-fingerprint cosine across the patent-compound collection, with each neighbour's top predicted target and the predicted targets it shares with this molecule.

Compoundsimilaritytop predictedshared targets
SCHEMBL16085665 0.97 GSK3A (0.54) GSK3AGSK3BEPHX2HRH3DDB1
SCHEMBL21247047 0.86 HRH3 (0.60) GSK3AGSK3BEPHX2HRH3KMT2A
SCHEMBL8659857 0.83 HRH3 (0.53) GSK3AGSK3BEPHX2HRH3GAA
SCHEMBL8214115 0.83 DDB1 (0.51) GSK3AGSK3BEPHX2HRH3DDB1
SCHEMBL5193417 0.81 GSK3A (0.51) GSK3AGSK3BEPHX2DDB1CRBN
SCHEMBL31033156 0.81 EPHX2 (0.60) GSK3AGSK3BEPHX2DDB1CRBN
SCHEMBL6188015 0.80 HRH3 (0.50) HRH3POLB
SCHEMBL1488276 0.79 L3MBTL1 (0.56) GSK3AGSK3BEPHX2DDB1CRBN
SCHEMBL877544 0.78 KMT2A (0.57) HRH3KMT2AMEN1
SCHEMBL9850086 0.77 DDB1 (0.69) GSK3AGSK3BEPHX2DDB1CRBN

Similarity is cosine over the 2,048-bit Morgan fingerprint (≈ Tanimoto). Identical fingerprints score 1.00.

Patent provenance — the patents this molecule appears in, and who filed them

Claimed or disclosed in 22 patents — showing the first 20. claimed = in the patent's claims; disclosed = body only.

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-20230373999-A1 KRAS G12C INHIBITORS MIRATI THERAPEUTICS INC (US) 2023-11-23 US disclosed
CN-109053523-B Azetidines as MEK inhibitors for the treatment of proliferative diseases 埃克塞利希斯股份有限公司 2022-03-25 CN disclosed
CN-111643496-A Methods of using MEK inhibitors 埃克塞利希斯股份有限公司 2020-09-11 CN disclosed
EP-3674297-A1 SUBSTITUTED N-ACETYL-L-CYSTEINE DERIVATIVES AND RELATED COMPOUNDS Promentis Pharmaceuticals, Inc. (US) 2020-07-01 EP disclosed
CN-107176927-B Histone demethylase LSD1 inhibitors 福建金乐医药科技有限公司 2020-02-18 CN disclosed
CN-110668988-A Azetidines as MEK inhibitors for the treatment of proliferative diseases 埃克塞利希斯股份有限公司 2020-01-10 CN disclosed
EP-3066089-B1 SUBSTITUTED N-ACETYL-L-CYSTEINE DERIVATIVES AND RELATED COMPOUNDS PROMENTIS PHARM INC (US) 2019-11-06 EP disclosed
CN-103524392-B As for treating the azetidine of the MEK inhibitor of proliferative disease 埃克塞利希斯股份有限公司 2018-06-01 CN disclosed
CN-104130960-B One strain Exiguobacterium sp and the application in controlling blue-green alga bloom of effective molten algae composition thereof 上海交通大学 2016-09-07 CN disclosed
US-6534506-B2 For therapy of cancer, neurofibromin benign proliferative disorder; blindness related to retinal vascularization; infections from hepatitis delta and related viruses; prophylaxis of restenosis; polycystic kidney disease MERCK & CO., INC. 2003-03-18 US disclosed
WO-2001077116-A1 INHIBITORS OF PRENYL-PROTEIN TRANSFERASE MERCK & CO., INC. (US) 2001-10-18 WO disclosed
WO-2001046200-A1 NOVEL PIPERIDINE AND PIPERAZINE DERIVATIVES ASTRAZENECA AB (SE) 2001-06-28 WO disclosed
EP-0819005-A4 2-ACYLAMINOPROPANAMIDES AS TACHYKININ RECEPTOR ANTAGONISTS LILLY CO ELI (US) 2001-03-21 EP disclosed
US-5773441-A PRODRUGS; ANIMAL HUSBANDRY ELI LILLY AND COMPANY (US) 1998-06-30 US disclosed
EP-0819005-A1 2-ACYLAMINOPROPANAMIDES AS TACHYKININ RECEPTOR ANTAGONISTS ELI LILLY AND COMPANY (US) 1998-01-21 EP disclosed
EP-0761220-A1 2-Acylaminopropanamides as growth hormone secretagogues ELI LILLY AND COMPANY (US) 1997-03-12 EP disclosed
WO-1997006803-A1 2-ACYLAMINOPROPANAMIDES AS GROWTH HORMONE SECRETAGOGUES ELI LILLY AND COMPANY (US) 1997-02-27 WO disclosed
US-5565568-A USEFUL IN TREATMENT OR PREVENTION OF A PHYSIOLOGICAL DISORDER ASSOCIATED WITH AN EXCESS OF TACHYKININS ELI LILLY AND COMPANY (US) 1996-10-15 US disclosed
WO-1996031214-A1 2-ACYLAMINOPROPANAMIDES AS TACHYKININ RECEPTOR ANTAGONISTS ELI LILLY AND COMPANY (US) 1996-10-10 WO disclosed
EP-0333036-A2 Separation method of alpha-L-aspartyl-L-phenylalanine methyl ester MITSUI TOATSU CHEMICALS, Inc. (JP) 1989-09-20 EP disclosed

Patent text — is the patent's own abstract consistent with the prediction?

For each of this compound's patents that has machine-readable text (1 of them — usually the abstract, not the full specification), we ask MedCPT which protein the text reads most about, and where the chemistry-predicted target lands among 4885 human targets. A high rank means the patent's own wording is consistent with the prediction — a weak, independent signal, not proof of activity.

PatentTitleText reads most aboutPredicted target · text-rank
US-20230373999-A1 KRAS G12C INHIBITORS KRAS, NRAS, HRAS GSK3A 478/4885GSK3B 371/4885EPHX2 2689/4885

“Text reads most about” is the patent abstract's nearest protein in MedCPT space (background-debiased). Only ~1.4% of patents have machine-readable text, so most compounds won't have this panel.